(5E,7E,9E)-13-(4-methoxyphenyl)-4,11-bis(oxidanyl)-1-piperidin-1-yl-trideca-5,7,9-trien-1-one

Systemtic Name: (5E,7E,9E)-13-(4-methoxyphenyl)-4,11-bis(oxidanyl)-1-piperidin-1-yl-trideca-5,7,9-trien-1-one Openeye Name: (5E,7E,9E)-4,11-dihydroxy-13-(4-methoxyphenyl)-1-(1-piperidyl)trideca-5,7,9-trien-1-one CAS Name: (5E,7E,9E)-4,11-dihydroxy-13-(4-methoxyphenyl)-1-(1-piperidinyl)-1-trideca-5,7,9-trienone IUPAC Name: (5E,7E,9E)-4,11-dihydroxy-13-(4-methoxyphenyl)-1-piperidin-1-yltrideca-5,7,9-trien-1-one Traditional Name: (5E,7E,9E)-4,11-dihydroxy-13-(4-methoxyphenyl)-1-piperidino-trideca-5,7,9-trien-1-one Formula: C25H35NO4 MolecularWeight: 413.5497

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Descriptors Computed from Structure

Canonical SMILES:

COC1=CC=C(C=C1)CCC(C=CC=CC=CC(CCC(=O)N2CCCCC2)O)O

Isomeric SMILES

COC1=CC=C(C=C1)CCC(/C=C/C=C/C=C/C(CCC(=O)N2CCCCC2)O)O

InChI

InChI=1S/C25H35NO4/c1-30-24-16-12-21(13-17-24)11-14-22(27)9-5-2-3-6-10-23(28)15-18-25(29)26-19-7-4-8-20-26/h2-3,5-6,9-10,12-13,16-17,22-23,27-28H,4,7-8,11,14-15,18-20H2,1H3/b3-2+,9-5+,10-6+